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1-(13Z-docosenoyl)-2-(6Z,9Z,12Z,15Z,18Z,21Z-tetracosahexaenoyl)-3-tridecanoyl-sn-glycerol

PropertiesImage
MNX_IDMNXM222822 Image of MNXM222822
referenceslm:000219083
formulaC62H106O6
global charge0
mol weight947.524
InChIKeyCUTIXOACZVUAGB-KCFQZJILSA-N
InChIInChI=1S/C62H106O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-33-35-37-39-41-44-47-50-53-56-62(65)68-59(57-66-60(63)54-51-48-45-42-21-18-15-12-9-6-3)58-67-61(64)55-52-49-46-43-40-38-36-34-32-29-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24-27,30-31,35,37,41,44,59H,4-6,8-9,11-15,17-18,20-23,28-29,32-34,36,38-40,42-43,45-58H2,1-3H3/b10-7-,19-16-,26-24-,27-25-,31-30-,37-35-,44-41-/t59-/m0/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@@H](COC(=O)CCCCCCCCCCCC)COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C62H106O6/c1-4-7-10-13-16-19-22-24-26-28-30-31-33-35-37-39-41-44-47-50-53-56-62(65)68-59(57-66-60(63)54-51-48-45-42-21-18-15-12-9-6-3)58-67-61(64)55-52-49-46-43-40-38-36-34-32-29-27-25-23-20-17-14-11-8-5-2/h7,10,16,19,24-27,30-31,35,37,41,44,59H,4-6,8-9,11-15,17-18,20-23,28-29,32-34,36,38-40,42-43,45-58H2,1-3H3/b10-7-,19-16-,26-24-,27-25-,31-30-,37-35-,44-41-/t59-/m0/s1 Image of MNXM222822
SMILES (mnx)[CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28]/[CH:30]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:39]/[CH:41]=[CH:44]\[CH2:47][CH2:50][CH2:53][CH2:56][C:62](=[O:65])[O:68][C@@H:59]([CH2:57][O:66][C:60]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:63])[CH2:58][O:67][C:61]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:29]/[CH:27]=[CH:25]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:64]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000219083
slm:000219083
CUTIXOACZVUAGB-KCFQZJILSA-N
1-(13Z-docosenoyl)-2-(6Z,9Z,12Z,15Z,18Z,21Z-tetracosahexaenoyl)-3-tridecanoyl-sn-glycerol
TG(22:1(13Z)/24:6(6Z,9Z,12Z,15Z,18Z,21Z)/13:0)
Triacylglycerol (22:1(13Z)/24:6(6Z,9Z,12Z,15Z,18Z,21Z)/13:0)